Density functional theory calculations of ultrathin epitaxial Au overlayers on CdS(0001)and CdS(0001̄)

Journal of Physical Chemistry C

Volumn 114, Issue 9, 2010, Pages 3998-4007

  De Paiva, R ^a   Di Felice, R ^a  

^a CNR   (Italy)

Author keywords

[No Author keywords available]

Indexed keywords

BI-LAYER; CDS; DENSITIES OF STATE; DENSITY FUNCTIONAL THEORY CALCULATIONS; ELECTRON WAVE FUNCTIONS; FIRST-PRINCIPLES; FORMATION ENERGIES; GENERALIZED GRADIENT APPROXIMATIONS; ORBITAL MIXING; OVERLAYERS; PLANE WAVE DENSITY FUNCTIONAL THEORY; PSEUDOPOTENTIALS; RICH CONDITIONS; SCHOTTKY BARRIER HEIGHTS; SIMILARITIES AND DIFFERENCES; ULTRA-THIN;

CADMIUM COMPOUNDS; CADMIUM SULFIDE; DATA STORAGE EQUIPMENT; ELECTRONIC PROPERTIES; SCHOTTKY BARRIER DIODES;

DENSITY FUNCTIONAL THEORY;

EID: 77949313302     PISSN: 19327447     EISSN: 19327455     Source Type: Journal    
DOI: 10.1021/jp910337b     Document Type: Article

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